2-[[(4-heptoxyphenyl)amino]methylidene]propanedioic acid

Systemtic Name: 2-[[(4-heptoxyphenyl)amino]methylidene]propanedioic acid Openeye Name: 2-[(4-heptoxyanilino)methylene]propanedioic acid CAS Name: 2-[(4-heptoxyanilino)methylidene]propanedioic acid IUPAC Name: 2-[(4-heptoxyanilino)methylidene]propanedioic acid Traditional Name: 2-[(4-heptoxyanilino)methylene]malonic acid Formula: C17H23NO5 MolecularWeight: 321.36822

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)NC=C(C(=O)O)C(=O)O

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)NC=C(C(=O)O)C(=O)O

InChI

InChI=1S/C17H23NO5/c1-2-3-4-5-6-11-23-14-9-7-13(8-10-14)18-12-15(16(19)20)17(21)22/h7-10,12,18H,2-6,11H2,1H3,(H,19,20)(H,21,22)